N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3,4-dimethyl-benzenesulfonamide

Systemtic Name: N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3,4-dimethyl-benzenesulfonamide Openeye Name: N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3,4-dimethyl-benzenesulfonamide CAS Name: N-[2-(4-ethyl-1-piperazin-4-iumyl)phenyl]-3,4-dimethylbenzenesulfonamide IUPAC Name: N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3,4-dimethylbenzenesulfonamide Traditional Name: N-[2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3,4-dimethyl-benzenesulfonamide Formula: C20H28N3O2S+ MolecularWeight: 374.52022

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=CC=CC=C2NS(=O)(=O)C3=CC(=C(C=C3)C)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=CC=CC=C2NS(=O)(=O)C3=CC(=C(C=C3)C)C

InChI

InChI=1S/C20H27N3O2S/c1-4-22-11-13-23(14-12-22)20-8-6-5-7-19(20)21-26(24,25)18-10-9-16(2)17(3)15-18/h5-10,15,21H,4,11-14H2,1-3H3/p+1